Acetamide, N-(4,7-dimethoxy-6-(2-(isopropylamino)ethoxy)-5-benzofuranyl)-, hydriodide

HCID 53395

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Basic information

CAS: 75883-39-5
Standard SMILES: COc1c(NC(C)=O)c(OCCNC(C)C)c(OC)c2occc12.I
InChIKey: QQOYTDXRBKWWBG-UHFFFAOYSA-N
Molecular formula: C17H25IN2O5
Average molar mass: 464.3 g/mol
Monoisotopic mass: 464.08082

Names & identifiers

Preferred name: Acetamide, N-(4,7-dimethoxy-6-(2-(isopropylamino)ethoxy)-5-benzofuranyl)-, hydriodide
IUPAC: N-[4,7-dimethoxy-6-[2-(propan-2-ylamino)ethoxy]-1-benzofuran-5-yl]acetamide;hydroiodide

Names & synonyms

N-(4,7-Dimethoxy-6-(2-(isopropylamino)ethoxy)-5-benzofuranyl)acetamide hydroiodide75883-39-5Acetamide, N-(4,7-dimethoxy-6-(2-(isopropylamino)ethoxy)-5-benzofuranyl)-, hydriodideRefChem:315223DTXSID00997269N-(4,7-Dimethoxy-6-{2-[(propan-2-yl)amino]ethoxy}-1-benzofuran-5-yl)ethanimidic acid--hydrogen iodide (1/1)

Database identifiers

CAS: 75883-39-5
PubChem CID: 53395
DTXSID: DTXSID00997269

Properties

Computed structural properties

Topological polar surface area: 82 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 6
Rotatable bonds: 8
Heavy atoms: 25
Formal charge: 0
Complexity: 406

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